Butyl methanesulfonate

Base Information

• Chemical Name: Butyl methanesulfonate
• CAS No.: 1912-32-9
• Molecular Formula: C5H12O3S
• Molecular Weight: 152.214
• Hs Code.: 29049090
• European Community (EC) Number: 217-620-4
• NSC Number: 36060
• UNII: 23G806JP9G
• DSSTox Substance ID: DTXSID6073281
• Nikkaji Number: J3.686B
• Wikidata: Q27253752
• Mol file: 1912-32-9.mol

Synonyms:butyl methanesulfonate;methyl butyl sulfonate

Chemical Property of Butyl methanesulfonate

Chemical Property:

• Vapor Pressure: 0.0459mmHg at 25°C
• Refractive Index: 1.429
• Boiling Point: 245.046 °C at 760 mmHg
• Flash Point: 102.001 °C
• PSA: 51.75000
• Density: 1.099 g/cm³
• LogP: 1.84350
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: Chloroform (Slightly), Methanol (Slightly)
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 152.05071541
• Heavy Atom Count: 9
• Complexity: 142

Purity/Quality:

98%,99%, ^*data from raw suppliers

Butyl methanesulfonate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R40:Possible risks of irreversible effects.
• Hazard Codes: Xn
• Statements: 22-36-43-36/37/38
• Safety Statements: 26-36/37-37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCOS(=O)(=O)C
• Uses: Butyl Methanesulfonate is a reactant used in the preparation of task-specific ionic liquids.

Technology Process of Butyl methanesulfonate

There total 9 articles about Butyl methanesulfonate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%

methanesulfonyl chloride (124-63-0) + butan-1-ol (71-36-3) → n-butyl methanesulfonate (1912-32-9)

Guidance literature:

butan-1-ol; With triethylamine; In dichloromethane; at 25 ℃;

methanesulfonyl chloride; In dichloromethane; at 0 - 20 ℃;

Reference yield: 96.0%

→ n-butyl methanesulfonate (1912-32-9)

Guidance literature:

With triethylamine; In tert-butyl methyl ether; at 0 - 20 ℃; for 2h;

Reference yield: 86.0%

2-butoxytetrahydropyran (1927-68-0) + methanesulfonyl chloride (124-63-0) → n-butyl methanesulfonate (1912-32-9)

Guidance literature:

With FeCl₃-Montmorillonite K-10; In acetonitrile; for 2h; Heating;

DOI:10.1515/znb-2005-0711

upstream raw materials:

methanesulfonyl chloride

sodium butanolate

butan-1-ol

C₉H₂₁O₅PS

Downstream raw materials:

2-sec-butyl-p-cresol

4-sec-Butyl-2,6-dimethyl-phenol

acetic acid butyl ester

dibutyl peroxide

Refernces

• 1、 Ivanova, Svetlana,Nitsch, Xavier,Romero-Sarria, Francisca,Louis, Beno?t,Centeno, Miguel Angel,Roger, Anne Cecile,Odriozola, Jose Antonio. "Ionic liquid protected heteropoly acids for methanol dehydration". . p. 236 - 241. Retrieved 2011.
• 2、 Ketsomboon, Nutthanicha,Saeeng, Rungnapha,Sirion, Uthaiwan,Srisook, Klaokwan. "Convenient synthesis of long alkyl-chain triazolylglycosides using ionic liquid as dual promoter-solvent: Readily access to non-ionic triazolylglycoside surfactants for evaluation of cytotoxic activity". . . Retrieved 2021/08/26.
• 3、 Li, Yue,Luan, Yu-Xin,Qi, Shao-Long,Wang, Rong-Hua,Ye, Mengchun,Zhang, Feng-Ping. "Carbamoyl Fluoride-Enabled Enantioselective Ni-Catalyzed Carbocarbamoylation of Unactivated Alkenes". supporting information. p. 19844 - 19849. Retrieved 2021/01/01.